(4-bromanyl-2-fluoranyl-phenyl)methyl 2-methoxy-5-nitro-benzoate

Systemtic Name: (4-bromanyl-2-fluoranyl-phenyl)methyl 2-methoxy-5-nitro-benzoate Openeye Name: (4-bromo-2-fluoro-phenyl)methyl 2-methoxy-5-nitro-benzoate CAS Name: 2-methoxy-5-nitrobenzoic acid (4-bromo-2-fluorophenyl)methyl ester IUPAC Name: (4-bromo-2-fluorophenyl)methyl 2-methoxy-5-nitrobenzoate Traditional Name: 2-methoxy-5-nitro-benzoic acid (4-bromo-2-fluoro-benzyl) ester Formula: C15H11BrFNO5 MolecularWeight: 384.153943

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)OCC2=C(C=C(C=C2)Br)F

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)OCC2=C(C=C(C=C2)Br)F

InChI

InChI=1S/C15H11BrFNO5/c1-22-14-5-4-11(18(20)21)7-12(14)15(19)23-8-9-2-3-10(16)6-13(9)17/h2-7H,8H2,1H3